N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine

C14H30N2O — CID 64532904

IUPACN-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine
SMILESCCCC(CC)NCC1CN(C(C)C)CCO1
InChIInChI=1S/C14H30N2O/c1-5-7-13(6-2)15-10-14-11-16(12(3)4)8-9-17-14/h12-15H,5-11H2,1-4H3
InChIKeyGUBLXGNEPZNZGT-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.26
Rot. Bonds7

About N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine

N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine (PubChem CID 64532904) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine.

Molecular Properties

Compound NameN-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine
PubChem CID64532904
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC NameN-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine
SMILESCCCC(CC)NCC1CN(C(C)C)CCO1
InChIInChI=1S/C14H30N2O/c1-5-7-13(6-2)15-10-14-11-16(12(3)4)8-9-17-14/h12-15H,5-11H2,1-4H3
InChIKeyGUBLXGNEPZNZGT-UHFFFAOYSA-N
XLogP2.26
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-propan-2-yl-2-propylmorpholine
CID 118118152
2-[(4-propan-2-ylmorpholin-2-yl)methylamino]propanoic acid
CID 64534343
2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine
CID 64532686
2-N,2-N-dimethyl-1-N-[(4-propan-2-ylmorpholin-2-yl)methyl]propane-1,2-diamine
CID 64535121
3-chloro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]butan-1-amine
CID 65024909
N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 82723781
(1R)-1-(2-methylphenyl)-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine
CID 81374031
N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pentan-3-amine
CID 61208503
1-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine
CID 79242000
2,3-dimethyl-3-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-2-ol
CID 106189997
4-[[(4-propan-2-ylmorpholin-2-yl)methylamino]methyl]oxan-4-ol
CID 81130459
(2S)-4-propan-2-yl-2-(propan-2-yloxymethyl)morpholine
CID 174286235

Frequently Asked Questions

What is the IUPAC name of N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine?
The IUPAC name of N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine (CID 64532904) is N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine.
What is the SMILES notation for N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine?
The canonical SMILES for N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine is CCCC(CC)NCC1CN(C(C)C)CCO1.
What is the InChIKey of N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine?
The InChIKey is GUBLXGNEPZNZGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-5-7-13(6-2)15-10-14-11-16(12(3)4)8-9-17-14/h12-15H,5-11H2,1-4H3.
What are the key properties of N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine?
N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine has a molecular weight of 242.41 g/mol, XLogP of 2.26, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine is sourced from PubChem (CID 64532904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).